Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1B | P49286 | 19/20 | 0.60 |
| ▸ | MTNR1A | P48039 | 18/20 | 0.60 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.60 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.60 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3062045 | 0.77 | MTNR1B (0.67) | MTNR1BMTNR1AABCB11SIGMAR1USP2 | |
| SCHEMBL3053825 | 0.77 | MTNR1B (0.67) | MTNR1BMTNR1AABCB11SIGMAR1USP2 | |
| (R)-Ramelteon SCHEMBL1566122 | 0.75 | MTNR1A (1.00) | MTNR1BMTNR1AABCB11SIGMAR1USP2 | |
| Ramelteon SCHEMBL29237 | 0.75 | MTNR1A (1.00) | MTNR1BMTNR1AABCB11SIGMAR1USP2 | |
| Ramelteon SCHEMBL29380213 | 0.75 | MTNR1A (1.00) | MTNR1BMTNR1AABCB11SIGMAR1USP2 | |
| (R)-Ramelteon SCHEMBL29827337 | 0.75 | MTNR1A (1.00) | MTNR1BMTNR1AABCB11SIGMAR1USP2 | |
| (R)-Ramelteon SCHEMBL338730 | 0.75 | MTNR1A (1.00) | MTNR1BMTNR1AABCB11SIGMAR1USP2 | |
| SCHEMBL1567202 | 0.73 | MTNR1B (0.67) | MTNR1BMTNR1AABCB11SIGMAR1USP2 | |
| SCHEMBL4688535 | 0.71 | MTNR1B (0.63) | MTNR1BMTNR1AABCB11SIGMAR1USP2 | |
| SCHEMBL8471961 | 0.69 | MTNR1A (0.53) | MTNR1BMTNR1A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5948817-A | Polycyclic ethyl alkylamide melatonergic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 1999-09-07 | — | — | US | claimed |
| WO-1998038991-A1 | POLYCYCLIC ETHYL ALKYLAMIDE MELATONERGIC AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-09-11 | — | — | WO | claimed |
| US-5948817-A | Polycyclic ethyl alkylamide melatonergic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 1999-09-07 | — | — | US | disclosed |
| WO-1998038991-A1 | POLYCYCLIC ETHYL ALKYLAMIDE MELATONERGIC AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-09-11 | — | — | WO | disclosed |